Geometry & MOs

Info

ID:	443008
PubChem CID:	135257363
Reduced:	ON2C10H18 (1)
Stoich.:	AB2C10D18 (1)
Weight, g/mol:	590.304562
ΔH_f, kcal/mol:	-59.82
Dipole, Da:	4.2
IP(EA), eV:	-8.41(1.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[4-(1,2,3,4,4a,9a-hexahydro-[1]benzofuro[2,3-b]pyridin-7-yl)phenyl]-N,N-diphenyl-1,2,3,4,4a,9b-hexahydropyrido[4,3-b]indol-8-amine

Drug info:

PubChemData

Smile

CN1CC2CC(C1)C(C2)CC(=O)N

DOS

IR

Vibrations